Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00528674
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
| Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
|---|---|---|---|---|---|
| Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
TNB | S-(2,3,6-TRINITROPHENYL)CYSTEINE | A,B,C,D,E,F, G,H | 1AQX | 0.86 |  |
NHP | 4-(2-AMINOPHENYLTHIO)-BUTYLPHOSPHONIC ACID | A,B | 1CX9 | 0.7 | |
NST | 3-{[(3-NITROANILINE]SULFONYL}THIOPHENE- 2-CARBOXYLIC ACID | B | 1XGI | 0.71 | |
CS1 | S-(2-ANILINYL-SULFANYL)-CYSTEINE | A,B | 2OMA | 0.73 | |
PSG | PARA-NITROPHENYL 1-THIO-BETA-D- GLUCOPYRANOSIDE | A,B | 1E1F | 0.74 | |
NPB | 3-NITROPHENYLBORONIC ACID | A,B | 1KDS | 0.72 | |
NIN | DINITROPHENYLENE | A | 1RSM | 0.75 | |
| NIN | DINITROPHENYLENE | A | 1GVY | 0.75 | |
| NIN | DINITROPHENYLENE | A | 1GW1 | 0.75 | |
AAS | 3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDE | A | 1CZM | 0.71 | |
53N | 3-[5-(3-nitrophenyl)thiophen-2- yl]propanoic acid | A | 3DN5 | 0.71 | |
GDN | GLUTATHIONE S-(2,4 DINITROBENZENE) | A,B | 5GST | 0.73 | |
| GDN | GLUTATHIONE S-(2,4 DINITROBENZENE) | A | 1HNA | 0.73 | |
| GDN | GLUTATHIONE S-(2,4 DINITROBENZENE) | A,B | 1VF3 | 0.73 | |
| GDN | GLUTATHIONE S-(2,4 DINITROBENZENE) | A,B,C,D | 1HNC | 0.73 | |
| GDN | GLUTATHIONE S-(2,4 DINITROBENZENE) | A,B,C | 1XWK | 0.73 | |
| GDN | GLUTATHIONE S-(2,4 DINITROBENZENE) | A,B | 18GS | 0.73 | |
| GDN | GLUTATHIONE S-(2,4 DINITROBENZENE) | A | 1GSQ | 0.73 | |
| GDN | GLUTATHIONE S-(2,4 DINITROBENZENE) | A,B | 1HNB | 0.73 | |
259 | 1-(methylsulfanyl)-4-nitrobenzene | X | 2RAZ | 0.81 | |